Vitas-M small molecule compound
methyl 3-[(E)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-1H-indole-2-carboxylate
Catalog ID
STK621955
SMILES COC(=O)c1[nH]c2c(c1/C=C\1/SC(=S)N(C1=O)Cc1ccccc1)cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H16N2O3S2 MW 408.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O3S2/c1-26-20(25)18-15(14-9-5-6-10-16(14)22-18)11-17-19(24)23(21(27)28-17)12-13-7-3-2-4-8-13/h2-11,22H,12H2,1H3/b17-11+InChIKey
GQAHQQKEKIXXHF-GZTJUZNOSA-NSynonyms
(E)methyl3((3benzyl4oxo2thioxothiazolidin5ylidene)methyl)1Hindole2carboxylate
COC(=O)c1(nH)c2c(c1C=C1SC(=S)N(C1=O)Cc1ccccc1)cccc2
COC(=O)C1=C(C2=CC=CC=C2N1)C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4
InChI=1SC21H16N2O3S2c12620(25)1815(149561016(14)2218)111719(24)23(21(27)2817)12137324813h21122H12H21H3b1711+
methyl3((E)(3benzyl4oxo2sulfanylidene13thiazolidin5ylidene)methyl)1Hindole2carboxylate
methyl3((E)(3benzyl4oxo2thioxo13thiazolidin5ylidene)methyl)1Hindole2carboxylate
MFCD09854533
ZINC000013718998
ZINC13718998
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